| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 23 | No |
Popular Name: N-benzyl-1-[1-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]methanamine N-benzyl-1-[1-[(3S)-1,1-dioxothi…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.24 | 5.84 | -59.11 | 2 | 5 | 1 | 69 | 334.465 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.24 | 4.47 | -15.76 | 1 | 5 | 0 | 64 | 333.457 | 5 | ↓ |
